1-[4-(1,3-benzothiazole-2-carbonyl)-1-(4-chlorophenyl)-1H-pyrazol-3-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(1,3-benzothiazole-2-carbonyl)-1-(4-chlorophenyl)-1H-pyrazol-3-yl]ethan-1-one
1-[4-(1,3-benzothiazole-2-carbonyl)-1-(4-chlorophenyl)-1H-pyrazol-3-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8011-6504 |
| Compound Name: | 1-[4-(1,3-benzothiazole-2-carbonyl)-1-(4-chlorophenyl)-1H-pyrazol-3-yl]ethan-1-one |
| Molecular Weight: | 381.84 |
| Molecular Formula: | C19 H12 Cl N3 O2 S |
| Smiles: | CC(c1c(cn(c2ccc(cc2)[Cl])n1)C(c1nc2ccccc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4519 |
| logD: | 4.4519 |
| logSw: | -4.7646 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.157 |
| InChI Key: | NLUXJLHEYYPUNJ-UHFFFAOYSA-N |